7-[[(2R)-3-methylbutan-2-yl]carbamoyl]-3-(2-methylpropyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[[(2R)-3-methylbutan-2-yl]carbamoyl]-3-(2-methylpropyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-[[(1R)-1,2-dimethylpropyl]carbamoyl]-3-isobutyl-2-thioxo-quinazolin-4-olate CAS Name: 7-[[[(2R)-3-methylbutan-2-yl]amino]-oxomethyl]-3-(2-methylpropyl)-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[[(2R)-3-methylbutan-2-yl]carbamoyl]-3-(2-methylpropyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-[[(1R)-1,2-dimethylpropyl]carbamoyl]-3-isobutyl-2-thioxo-quinazolin-4-olate Formula: C18H24N3O2S- MolecularWeight: 346.46706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC(C)C(C)C)[O-]

Isomeric SMILES

C[C@H](C(C)C)NC(=O)C1=CC2=NC(=S)N(C(=C2C=C1)[O-])CC(C)C

InChI

InChI=1S/C18H25N3O2S/c1-10(2)9-21-17(23)14-7-6-13(8-15(14)20-18(21)24)16(22)19-12(5)11(3)4/h6-8,10-12,23H,9H2,1-5H3,(H,19,22)/p-1/t12-/m1/s1